4-[(5-chloranyl-2-methoxy-phenyl)amino]-4-oxidanylidene-2-piperazin-1-yl-butanoic acid

Systemtic Name: 4-[(5-chloranyl-2-methoxy-phenyl)amino]-4-oxidanylidene-2-piperazin-1-yl-butanoic acid Openeye Name: 4-(5-chloro-2-methoxy-anilino)-4-oxo-2-piperazin-1-yl-butanoic acid CAS Name: 4-(5-chloro-2-methoxyanilino)-4-oxo-2-(1-piperazinyl)butanoic acid IUPAC Name: 4-(5-chloro-2-methoxyanilino)-4-oxo-2-piperazin-1-ylbutanoic acid Traditional Name: 4-(5-chloro-2-methoxy-anilino)-4-keto-2-piperazino-butyric acid Formula: C15H20ClN3O4 MolecularWeight: 341.79

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CC(C(=O)O)N2CCNCC2

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CC(C(=O)O)N2CCNCC2

InChI

InChI=1S/C15H20ClN3O4/c1-23-13-3-2-10(16)8-11(13)18-14(20)9-12(15(21)22)19-6-4-17-5-7-19/h2-3,8,12,17H,4-7,9H2,1H3,(H,18,20)(H,21,22)